AG007MB0

134395-00-9 | (3R,5R)-tert-Butyl 7-(2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl)-3,5-dihydroxyheptanoate

AG007MB0

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	134395-00-9
Catalog Number	AG007MB0(AGN-PC-0PKA41)
Chemical Name	(3R,5R)-tert-Butyl 7-(2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl)-3,5-dihydroxyheptanoate
EC Number	603-817-6
IUPAC Name	tert-butyl (3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoate
InChI	InChI=1S/C37H43FN2O5/c1-24(2)34-33(36(44)39-28-14-10-7-11-15-28)32(25-12-8-6-9-13-25)35(26-16-18-27(38)19-17-26)40(34)21-20-29(41)22-30(42)23-31(43)45-37(3,4)5/h6-19,24,29-30,41-42H,20-23H2,1-5H3,(H,39,44)/t29-,30-/m1/s1
InChI Key	GCPKKGVOCBYRML-LOYHVIPDSA-N
MDL Number	MFCD09839952
Molecular Formula	C37H43FN2O5
Molecular Weight	614.7461
SMILES	CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(=O)OC(C)(C)C)C1=CC=C(F)C=C1)C1=CC=CC=C1
Synonyms	Atorvastatin tert-Butyl Ester, 134395-00-9, (3R,5R)-tert-Butyl 7-(2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl)-3,5-dihydroxyheptanoate, AK-50672, SCHEMBL538509, C37H43FN2O5, CTK8E9667, DTXSID30459683, GCPKKGVOCBYRML-LOYHVIPDSA-N, KS-00000P0E, 6189AA, EBD233332, MFCD09839952, ZINC67664922, DS-15506, RT-011337, FT-0662323, ST24034493, J-006530, (|AR,|AR)-2-(4-Fluorophenyl)-|A,|A-dihydroxy-5-(1-methylethyl)-3-phenyl-4-[(phenylamino)carbonyl]-1H-pyrrole-1-heptanoic Acid 1,1-Dimethylethyl Ester, (3R,5R)-7-[2-(4-Fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrole-1-yl]-3,5-dihydroxyheptanoic acid tert-butyl ester, (3R,5R)-7-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-phenylcarbamoyl-pyrrol-1-yl]-3,5-dihydroxy-heptanoic acid, t-butyl ester, (3R,5R)-7-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-phenylcarbamoyl-pyrrol-1-yl]-3,5dihydroxy-heptanoic acid, t-butyl ester, (I(2)R,I R)2-(4-fluorophenyl)-I(2),I -dihydroxy-5-(1-methylethyl)-3-phenyl-4-[(phenylamino)carbonyl]-1H-pyrrole-1-heptanoic acid t-butyl ester;, [R-(R*,R*)]-2-(4-fluorophenyl)-I(2),I -dihydroxy-5-(1-methyl- ethyl)-3-phenyl-4- [(phenylamino)carbonyl]-1H-pyrrole-1-heptanoic acid tertiary butyl ester;, [R-(R*,R*)]-2-(4-fluorophenyl)-I(2),I -dihydroxy-5-(1-methyl-ethyl)-3-phenyl-4-[(phenylamino)carbonyl]-1H-pyrrole-1-heptanoic acid tertiary butyl ester;, [R-(R*,R*)]-2-(4-fluorophenyl)-I(2),I -dihydroxy-5-(1-methylethyl)-3-phenyl-4-[(phenylamino)carbonyl]-1H-pyrrole-1-heptanoic acid tertiary butyl ester;, [R-(R*,R*)]-2-(4-fluorophenyl)-I(2)I -dihydroxy-5-(1-methyl- ethyl)-3-phenyl-4- [(phenylamino)carbonyl]-1H-pyrrole-1-heptanoic acid tertiary butyl ester;, [R-(R*,R*)]-2-(4-fluorophenyl)I(2),I -dihydroxy-5-(1-methylethyl)-3-phenyl-4-[phenylaminocarbonyl]-1-H-pyrrole-1-heptanoic acid tertiary, tert-butyl (3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoate, tert-butyl (3R,5R)-7-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)pyrrol-1-yl]-3,5-dihydroxyheptanoate, tert-butyl (3R,5R)-7-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)pyrrol-1-yl]-3,5-dihydroxyheptanoate;, Atorvastatin Acid t-Butyl Ester, CS-O-07281, CID11238911, CID 11238911,

Complexity	920
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	614.316g/mol
Formal Charge	0
Heavy Atom Count	45
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	614.758g/mol
Monoisotopic Mass	614.316g/mol
Rotatable Bond Count	14
Topological Polar Surface Area	101A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	6.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number